2,2-diethoxy-6-prop-1-en-2-yloxasilinane

C11H22O3Si — CID 175223390

IUPAC2,2-diethoxy-6-prop-1-en-2-yloxasilinane
SMILESC=C(C)C1CCC[Si](OCC)(OCC)O1
InChIInChI=1S/C11H22O3Si/c1-5-12-15(13-6-2)9-7-8-11(14-15)10(3)4/h11H,3,5-9H2,1-2,4H3
InChIKeyPOVTXRFQOBVJHG-UHFFFAOYSA-N
MW230.38 g/mol
LogP2.75
Rot. Bonds5

About 2,2-diethoxy-6-prop-1-en-2-yloxasilinane

2,2-diethoxy-6-prop-1-en-2-yloxasilinane (PubChem CID 175223390) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is 2,2-diethoxy-6-prop-1-en-2-yloxasilinane.

Molecular Properties

Compound Name2,2-diethoxy-6-prop-1-en-2-yloxasilinane
PubChem CID175223390
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Name2,2-diethoxy-6-prop-1-en-2-yloxasilinane
SMILESC=C(C)C1CCC[Si](OCC)(OCC)O1
InChIInChI=1S/C11H22O3Si/c1-5-12-15(13-6-2)9-7-8-11(14-15)10(3)4/h11H,3,5-9H2,1-2,4H3
InChIKeyPOVTXRFQOBVJHG-UHFFFAOYSA-N
XLogP2.75
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethoxy-6-prop-1-en-2-yloxasilinane?
The IUPAC name of 2,2-diethoxy-6-prop-1-en-2-yloxasilinane (CID 175223390) is 2,2-diethoxy-6-prop-1-en-2-yloxasilinane.
What is the SMILES notation for 2,2-diethoxy-6-prop-1-en-2-yloxasilinane?
The canonical SMILES for 2,2-diethoxy-6-prop-1-en-2-yloxasilinane is C=C(C)C1CCC[Si](OCC)(OCC)O1.
What is the InChIKey of 2,2-diethoxy-6-prop-1-en-2-yloxasilinane?
The InChIKey is POVTXRFQOBVJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-5-12-15(13-6-2)9-7-8-11(14-15)10(3)4/h11H,3,5-9H2,1-2,4H3.
What are the key properties of 2,2-diethoxy-6-prop-1-en-2-yloxasilinane?
2,2-diethoxy-6-prop-1-en-2-yloxasilinane has a molecular weight of 230.38 g/mol, XLogP of 2.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethoxy-6-prop-1-en-2-yloxasilinane is sourced from PubChem (CID 175223390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).